METANITROBENZENE SULFONIC ACID, SODIUM SALT

Synonyms:
127-68-4; SODIUM 3-NITROBENZENESULFONATE; Sodium 3; nitrobenzenesulphonate; 3-Nitrobenzenesulfonic acid sodium salt; Sodium m-nitrobenzenesulfonate; Nitrol S; Tiskan [Czech]; Benzenesulfonic acid, 3-nitro-, sodium salt; Ludigol; Ludigol F,60; UNII-1F11SXJ4C6; Tiskan; 3-Nitrobenzenesulfonic acid, sodium salt; Benzenesulfonic acid, 3-nitro-, sodium salt (1:1); HSDB 5614; NSC 9795; EINECS 204-857-3; MFCD00007490; Nitrobenzen-m-sulfonan sodny [Czech]; m-Nitrobenzenesulfonic acid sodium salt; m-Nitrobenzenesulfonic acid, sodium salt; sodium m-nitrobenzene sulfonate;  1F11SXJ4C6; Benzenesulfonic acid, m-nitro-, sodium salt; sodium 3-nitrobenzene-1-sulfonate; Nitrobenzen-m-sulfonan sodny; m-nitrobenzene sulfonic acid sodium salt; 3-Nitrobenzenesulfonic acid, sodium salt, 99%; Resist Salt; sodium 3-nitrobenzenesulfonate,3-nitrobenzenesulfonic acid sodium salt,sodium 3-nitrobenzenesulphonate,sodium m-nitrobenzenesulfonate,nitrol s,tiskan czech,ludigol,ludigol f,60,benzenesulfonic acid, 3-nitro-, sodium salt,unii-1f11sxj4c6; nitrobenzen-m-sulfonan sodny; 3-nitrobenzene sulfonic acid sodium salt; m-nitrobenzenesulfonic acid sodium salt; 3-nitrobenzenesulfonic acid, sodium salt; m-nitrobenzenesulfonic acid, sodium salt; nitrol S; sodium 3-nitrobenzene sulfonate; sodium 3-nitrobenzenesulfonate; sodium 3-nitrobenzenesulphonate; sodium meta-nitrobenzene sulfonate; sodium;3-nitrobenzenesulfonate; tiskan; METANITROBENZENE SULFONIC ACID, SODIUM SALT; Metanitrobenzene Sulfonic Acid, Sodium Salt; Metanitrobenzene Sulfonic Acid, Sodium Salt; Metanitrobenzene Sulfonic Acid, Sodium Salt; Metanitrobenzene Sulfonic Acid, Sodium Salt; Metanitrobenzene Sulfonic Acid, Sodium Salt; Meta Nitrobenzene Sulfonic Acid, Sodium Salt; Meta Nitro Benzene Sulfonic Acid, Sodium Salt; Metanitrobenzene Sulphonic Acid, Sodium Salt; Metanitrobenzene Sulfonik Acid, Sodium Salt;METANITROBENZENE SULFONIC ACID, SODIUM SALT; METANITROBENZENE SULFONIC ACID, SODIUM SALT; METANİTROBENZENE SULFONİC ACID, SODİUM SALT; METANİTROBENZENE SULFONİC ACID, SODİUM SALT; METANİTROBENZENE SULFONİC ACID, SODİUM SALT; META NİTROBENZENE SULFONİC ACID, SODİUM SALT; META NİTRO BENZENE SULFONİC ACID, SODİUM SALT; METANİTROBENZENE SULPHONİC ACID, SODİUM SALT; METANİTROBENZENE SULFONİK ACID, SODİUM SALT; METANITROBENZENE SULFONIC ACID, SODIUM SALT

METANITROBENZENE SULFONIC ACID, SODIUM SALT

Sodium 3-nitrobenzenesulfonate (Metanitrobenzene sulfonic acid, sodium salt) is used in the synthesis of quinoline. Metanitrobenzene sulfonic acid, sodium salt is generally immediately available in most volumes. High purity, submicron and nanopowder forms may be considered. It is produced to many standard grades when applicable, including Mil Spec (military grade); ACS, Reagent and Technical Grade; Food, Agricultural and Pharmaceutical Grade; Optical Grade, USP and EP/BP (European Pharmacopoeia/British Pharmacopoeia) and follows applicable ASTM testing standards. Typical and custom packaging is available. Additional technical, research and safety (MSDS) information is available as is a Reference Calculator for converting relevant units of measurement. 

Product Information
CAS number of Metanitrobenzene sulfonic acid, sodium salt:    127-68-4
EC index number of Metanitrobenzene sulfonic acid, sodium salt:    609-048-00-2
EC number of Metanitrobenzene sulfonic acid, sodium salt:    204-857-3
Hill Formula of Metanitrobenzene sulfonic acid, sodium salt:    C₆H₄NNaO₅S
Chemical formula of Metanitrobenzene sulfonic acid, sodium salt:    3-(NO₂)C₆H₄SO₃Na
Molar Mass of Metanitrobenzene sulfonic acid, sodium salt:    225.16 g/mol
HS Code of Metanitrobenzene sulfonic acid, sodium salt:    2904 99 00
Structure formula Image    Structure formula Image
Quality Level of Metanitrobenzene sulfonic acid, sodium salt:    MQ200

 Properties  of Metanitrobenzene sulfonic acid, sodium salt:(Theoretical)
Compound Formula of Metanitrobenzene sulfonic acid, sodium salt:    C6H4NNaO5S
Molecular Weight of Metanitrobenzene sulfonic acid, sodium salt:    225.15
Appearance of Metanitrobenzene sulfonic acid, sodium salt:    Off-white to yellow powder
Melting Point     of Metanitrobenzene sulfonic acid, sodium salt:350 °C
Boiling Point of Metanitrobenzene sulfonic acid, sodium salt:    N/A
Density of Metanitrobenzene sulfonic acid, sodium salt:    N/A
Solubility  of Metanitrobenzene sulfonic acid, sodium salt in H2O    N/A
pH of Metanitrobenzene sulfonic acid, sodium salt:    6-10 (1% aq. soln)
Exact Mass of Metanitrobenzene sulfonic acid, sodium salt:    224.970788
Monoisotopic Mass of Metanitrobenzene sulfonic acid, sodium salt:    224.970788

Calculated properties of Metanitrobenzene sulfonic acid, sodium salt:
Property name Property value Reference
Molecular Weight Of Metanitrobenzene Sulfonic Acid, Sodium Salt: 225.16 g / mol calculated by PubChem 2.1 (PubChem release 2019.06.18)
Number of hydrogen bond donors From Metanitrobenzene Sulfonic Acid, Sodium Salt: 0 calculated by Cactvs 3.4.6.11 (PubChem release 2019.06.18)
Number of hydrogen bond acceptors Du Metanitrobenzene Sulfonic Acid, Sodium Salt: 5 calculated by Cactvs 3.4.6.11 (PubChem release 2019.06.18)
Number of rotary bonds of Metanitrobenzene Sulfonic Acid, Sodium Salt: 0 calculated by Cactvs 3.4.6.11 (PubChem release 2019.06.18)
Exact mass of Metanitrobenzene Sulfonic Acid, Sodium Salt: 224.970788 g / mol calculated by PubChem 2.1 (PubChem release 2019.06.18)
Monoisotopic mass of Metanitrobenzene Sulfonic Acid, Sodium Salt: 224.970788 g / mol calculated by PubChem 2.1 (PubChem release 2019.06.18)
Topological polar surface of Metanitrobenzene Sulfonic Acid, Sodium Salt: 111 Ų calculated by Cactvs 3.4.6.11 (PubChem release 2019.06.18)
Number of heavy atoms Of Metanitrobenzene Sulfonic Acid, Sodium Salt: 14 calculated by PubChem
Formal charge of Metanitrobenzene Sulfonic Acid, Sodium Salt: 0 calculated by PubChem
Complexity 274 calculated by Cactvs 3.4.6.11 (PubChem version 2019.06.18)
Number of isotopic atoms Of Metanitrobenzene Sulfonic Acid, Sodium Salt: 0 calculated by PubChem
Defined number of atomic stereocenters Of Metanitrobenzene Sulfonic Acid, Sodium Salt: 0 calculated by PubChem
Number of undefined atomic stereocenter Of Metanitrobenzene Sulfonic Acid, Sodium Salt: 0 calculated by PubChem
Defined number of bond stereocenters From Metanitrobenzene Sulfonic Acid, Sodium Salt: 0 calculated by PubChem
Number of undefined binding stereocentre Du Metanitrobenzene Sulfonic Acid, Sodium Salt: 0 calculated by PubChem
Number of covalently linked units Of Metanitrobenzene Sulfonic Acid, Sodium Salt: 2 calculated by PubChem
The compound is canonized From Metanitrobenzene Sulfonic Acid, Sodium Salt: Yes

Characteristics Of Metanitrobenzene Sulfonic Acid, Sodium Salt:
Packaging plastic bottle
Quantity Of Metanitrobenzene Sulfonic Acid 1kg
Authentic Metanitrobenzene Sulfonic Acid Spectrum
Metanitrobenzene Sulfonic Acid Color yellow
Melting Point Of Metanitrobenzene Sulfonic Acid 350.0 ° C
pH of Metanitrobenzene Sulfonic Acid 6 to 10 (1% aqueous solution)
Flash point Of Metanitrobenzene Sulfonic Acid> 100 ° C
CAS Min Du Metanitrobenzene Sulfonic Acid% 98.5
CAS max Du Metanitrobenzene Sulfonic Acid% 100.0

Percentage Range Of Metanitrobenzene Sulfonic Acid 98.5% min. (HPLC)
Linear Formula Of Metanitrobenzene Sulfonic AcidO2NC6H4SO3Na
Beilstein Du Metanitrobenzene Sulfonic Acid 11, 68
Solubility information Solubility in water: 200g / L of water (20 ° C)
Formula Weight Of Metanitrobenzene Sulfonic Acid 225.15
Crystalline Powder In Physical Form Metanitrobenzene Sulfonic Acid
Percent Purity Of Metanitrobenzene Sulfonic Acid99%
Chemical name or material 3-Nitrobenzenesulfonic acid, sodium salt

Properties Of Metanitrobenzene Sulfonic Acid, Sodium Salt:
Related categories Building Blocks, Chemical Synthesis, Organic Building Blocks, Sulfonic Acid / Sulfinic Salts, Sulfur Compounds Less ...
test 98%
solubility in water: 50 mg / mL, clear to slightly cloudy, slightly yellow to yellow
SMILES string [Na +]. [O -] [N +] (= O) c1cccc (c1) S ([O -]) (= O) = O
InChI 1S / C6H5NO5S.Na / c8-7 (9) 5-2-1-3-6 (4-5) 13 (10.11) 12; / h1-4H, (H, 10,11,12); / q; + 1 / p-1
InChI key LJRGBERXYNQPJI-UHFFFAOYSA-M
The description
Application
Sodium 3-nitrobenzenesulfonate (sodium salt of 3-nitrobenzenesulfonic acid) has been used in the synthesis of quinoline [1].

CASE Of Metanitrobenzene Sulfonic Acid, Sodium Salt:
127-68-4
Molecular Formula Of Metanitrobenzene Sulfonic Acid, Sodium Salt:
C6H4NNaO5S
Molecular Weight Du Metanitrobenzene Sulfonic Acid, Sodium Salt: (g / mol)
225.15

Characteristics Of Metanitrobenzene Sulfonic Acid, Sodium Salt:
Packaging plastic bottle
Quantity Of Metanitrobenzene Sulfonic Acid 1kg
Authentic Metanitrobenzene Sulfonic Acid Spectrum
Metanitrobenzene Sulfonic Acid Color yellow
Melting Point Of Metanitrobenzene Sulfonic Acid 350.0 ° C
pH of Metanitrobenzene Sulfonic Acid 6 to 10 (1% aqueous solution)
Flash point Of Metanitrobenzene Sulfonic Acid> 100 ° C
CAS Min Du Metanitrobenzene Sulfonic Acid% 98.5
CAS max Du Metanitrobenzene Sulfonic Acid% 100.0
Percentage Range Of Metanitrobenzene Sulfonic Acid 98.5% min. (HPLC)
Linear Formula Of Metanitrobenzene Sulfonic AcidO2NC6H4SO3Na
Beilstein Du Metanitrobenzene Sulfonic Acid 11, 68
Solubility information Solubility in water: 200g / L of water (20 ° C)
Formula Weight Of Metanitrobenzene Sulfonic Acid 225.15
Crystalline powder Physical form of Metanitrobenzene Sulfonic Acid
Percent Purity Of Metanitrobenzene Sulfonic Acid99%
Chemical name or material 3-Nitrobenzenesulfonic acid, sodium salt